91749657 OpenBabel04211813443D 45 46 0 0 0 0 0 0 0 0999 V2000 10.9296 -1.6966 0.1471 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0490 -3.9657 0.3586 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4213 1.4490 -0.6865 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9824 2.5407 0.2921 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9140 1.2783 -1.0053 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7715 2.7912 -0.6202 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4438 1.9861 1.6574 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1967 0.1949 -0.1578 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1902 0.5206 0.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1593 2.0547 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4181 0.8643 1.3604 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6439 0.5795 0.2261 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2026 -0.5608 -0.2573 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4427 -0.6808 0.4233 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7719 -0.6647 0.3057 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5494 -1.9432 0.4425 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4932 0.6156 -0.0234 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6358 -2.8996 0.1396 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1094 -2.9017 -0.1492 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6807 3.3858 0.3636 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6746 1.0262 -2.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8482 3.0522 -0.1029 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9433 3.4945 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2704 1.5832 2.2425 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9603 2.7882 2.2151 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6851 -0.2000 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2221 -0.5666 -0.9372 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4593 1.2559 -2.5812 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0441 2.5918 -1.5613 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4955 2.7438 -2.4252 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8917 0.3642 2.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0888 1.1745 -0.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6367 1.1573 1.1504 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7908 -0.9843 0.6587 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 -1.3439 -0.8253 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3959 -0.1384 -0.8564 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9319 -1.6132 0.6638 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1557 -2.6840 -0.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4573 -2.3170 1.4622 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5653 0.4261 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2932 1.3555 0.7517 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1440 0.9933 -0.9844 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4860 -3.9238 -0.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6269 -2.2968 0.5954 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2863 -2.4860 -1.1411 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 18 1 0 0 0 0 2 18 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 1 0 0 0 3 10 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 20 1 1 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 21 1 6 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 11 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 12 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 11 2 0 0 0 0 9 13 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 M END